9-[(3-chlorophenyl)methyl]carbazole-3-carboximidamide

C20H16ClN3 — CID 142911101

IUPAC9-[(3-chlorophenyl)methyl]carbazole-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc2c(c1)c1ccccc1n2Cc1cccc(Cl)c1
InChIInChI=1S/C20H16ClN3/c21-15-5-3-4-13(10-15)12-24-18-7-2-1-6-16(18)17-11-14(20(22)23)8-9-19(17)24/h1-11H,12H2,(H3,22,23)
InChIKeyFAUIUWGDPOGJEC-UHFFFAOYSA-N
MW333.82 g/mol
LogP4.78
Rot. Bonds3

About 9-[(3-chlorophenyl)methyl]carbazole-3-carboximidamide

9-[(3-chlorophenyl)methyl]carbazole-3-carboximidamide (PubChem CID 142911101) has the molecular formula C20H16ClN3 and a molecular weight of 333.82 g/mol. Its IUPAC name is 9-[(3-chlorophenyl)methyl]carbazole-3-carboximidamide.

Molecular Properties

Compound Name9-[(3-chlorophenyl)methyl]carbazole-3-carboximidamide
PubChem CID142911101
Molecular FormulaC20H16ClN3
Molecular Weight333.82 g/mol
Exact Mass333.10
IUPAC Name9-[(3-chlorophenyl)methyl]carbazole-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc2c(c1)c1ccccc1n2Cc1cccc(Cl)c1
InChIInChI=1S/C20H16ClN3/c21-15-5-3-4-13(10-15)12-24-18-7-2-1-6-16(18)17-11-14(20(22)23)8-9-19(17)24/h1-11H,12H2,(H3,22,23)
InChIKeyFAUIUWGDPOGJEC-UHFFFAOYSA-N
XLogP4.78
TPSA54.80 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.82
LogP ≤ 54.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 9-[(3-chlorophenyl)methyl]carbazole-3-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9-[(2-methylphenyl)methyl]carbazole-3-carboximidamide
CID 142911316
9-[[4-(2-cyanophenyl)phenyl]methyl]carbazole-3-carboximidamide;hydrazine
CID 142938358
9-benzyl-N-iminocarbazole-3-carboximidamide
CID 142911388
N-benzyl-2-(3-carbamimidoylcarbazol-9-yl)-N-phenylacetamide
CID 142911045
N-hydrazinylidene-9-[[4-(1-hydroxyethenyl)phenyl]methyl]carbazole-3-carboximidamide
CID 142938962
N'-diazenyl-9-[(3-methoxyphenyl)methyl]carbazole-3-carboximidamide
CID 154537128
N,1-bis[(3-carbamimidoylphenyl)methyl]-3-chloroindole-2-carboxamide
CID 10389462
9-[(3-chlorophenyl)methyl]pyrido[3,4-b]indole
CID 141321511
9-[[3-(carbazol-9-ylmethyl)phenyl]methyl]carbazole
CID 67781407
N'-amino-9-[(4-methylphenyl)methyl]carbazole-3-carboximidamide
CID 143271307
1-[(3-carbamimidoylphenyl)methyl]-4-methylindole-2-carboxamide
CID 10946700
9-[(2-chlorophenyl)methyl]-N-hydrazinylidenecarbazole-3-carboximidamide
CID 142223725

Frequently Asked Questions

What is the IUPAC name of 9-[(3-chlorophenyl)methyl]carbazole-3-carboximidamide?
The IUPAC name of 9-[(3-chlorophenyl)methyl]carbazole-3-carboximidamide (CID 142911101) is 9-[(3-chlorophenyl)methyl]carbazole-3-carboximidamide.
What is the SMILES notation for 9-[(3-chlorophenyl)methyl]carbazole-3-carboximidamide?
The canonical SMILES for 9-[(3-chlorophenyl)methyl]carbazole-3-carboximidamide is [H]/N=C(\N)c1ccc2c(c1)c1ccccc1n2Cc1cccc(Cl)c1.
What is the InChIKey of 9-[(3-chlorophenyl)methyl]carbazole-3-carboximidamide?
The InChIKey is FAUIUWGDPOGJEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClN3/c21-15-5-3-4-13(10-15)12-24-18-7-2-1-6-16(18)17-11-14(20(22)23)8-9-19(17)24/h1-11H,12H2,(H3,22,23).
What are the key properties of 9-[(3-chlorophenyl)methyl]carbazole-3-carboximidamide?
9-[(3-chlorophenyl)methyl]carbazole-3-carboximidamide has a molecular weight of 333.82 g/mol, XLogP of 4.78, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[(3-chlorophenyl)methyl]carbazole-3-carboximidamide is sourced from PubChem (CID 142911101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).